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Molecule
1,2-Diformylhydrazine
CAS: 628-36-4 · C2H4N2O2
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 628-36-4
- Molecular Formula
- C2H4N2O2
- Molecular Mass
- 88.07 g/mol
Identifiers
CAS Registry Number
628-36-4
SMILES
OC=NN=CO
InChI Key
POVXOWVFLAAVBH-UHFFFAOYSA-N
InChI
InChI=1S/C2H4N2O2/c5-1-3-4-2-6/h1-2H,(H,3,5)(H,4,6)
Names and Synonyms
- 1,2-Diformylhydrazine Synonym
- 1,2-Hydrazinedicarboxaldehyde Synonym
- Hydrazine, 1,2-diformyl- Synonym
- Bicarbamaldehyde Synonym
- 1,2-Diformylhydrazine Synonym
- Diformylhydrazine Synonym
- N,N′-Diformylhydrazine Synonym
- s-Diformylhydrazine Synonym
- Diformohydrazide Synonym
- s-Diformohydrazide Synonym
- Diformylhydrazide Synonym
- NSC 54729 Synonym
- N′-Formylformic hydrazine Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 88.07 g/mol | CAS Common Chemistry |
| 88.06599999999999 g/mol | RDKit | |
| 88.066 g/mol | RDKit | |
| Wikipedia Url | https://en.wikipedia.org/wiki/1,2-Diformylhydrazine | CAS Common Chemistry |
| Canonical SMILES | O=CNNC=O | CAS Common Chemistry |
| InChI | InChI=1S/C2H4N2O2/c5-1-3-4-2-6/h1-2H,(H,3,5)(H,4,6) | CAS Common Chemistry |
| InChI Key | InChIKey=POVXOWVFLAAVBH-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 156 °C | CAS Common Chemistry |
| Name | 1,2-Hydrazinedicarboxaldehyde | CAS Common Chemistry |
| 1,2-Diformylhydrazine | CAS Common Chemistry | |
| Heavy Atom Count | 6 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 2 | RDKit |
| Rotatable Bonds | 1 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 65.18 Ų | RDKit |
| LogP | 0.07399999999999995 | RDKit |
| 0.074 | RDKit | |
| Molar Refractivity | 22.2416 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 88.027277368 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
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200 ppm
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| Shift (ppm) | DEPT | Assignment |
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Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
External Resources
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MW = 88.07 g/mol. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C2H4N2O2.
